Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 4/20 | 0.61 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.59 |
| ▸ | MITF | O75030 | 1/20 | 0.58 |
| ▸ | NPC1 | O15118 | 3/20 | 0.57 |
| ▸ | RAB9A | P51151 | 3/20 | 0.57 |
| ▸ | ATM | Q13315 | 1/20 | 0.57 |
| ▸ | ABL1 | P00519 | 3/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.54 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | SNCA | P37840 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.51 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.51 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL23657648 | 0.88 | TRPV1 (0.78) | TRPV1PTPN1MITFNPC1RAB9A | |
| SCHEMBL29832702 | 0.87 | ABL1 (0.62) | TRPV1PTPN1NPC1RAB9AABL1 | |
| Hydrochloric Acid SCHEMBL5797909 | 0.87 | TRPV1 (0.76) | TRPV1PTPN1MITFNPC1RAB9A | |
| SCHEMBL23091708 | 0.83 | TRPV1 (0.47) | TRPV1PTPN1NPC1RAB9AABL1 | |
| SCHEMBL15388371 | 0.81 | ABL1 (0.55) | TRPV1ABL1ALDH1A1MEN1KMT2A | |
| SCHEMBL20254169 | 0.81 | PTPN1 (0.71) | PTPN1MITFNPC1RAB9AATM | |
| SCHEMBL10684470 | 0.80 | PTPN1 (0.88) | PTPN1MITFNPC1RAB9AATM | |
| SCHEMBL24850252 | 0.80 | ABL1 (0.53) | TRPV1ABL1ALDH1A1MEN1POLB | |
| SCHEMBL28932363 | 0.79 | TRPV1 (0.50) | TRPV1ABL1ALDH1A1MEN1KMT2A | |
| SCHEMBL6295993 | 0.78 | NPC1 (0.83) | PTPN1MITFNPC1RAB9AATM |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104302638-B | BENZAMIDE DERIVATIVES FOR INHIBITING THE ACTIVITY OF ABL1, ABL2 AND BCR-ABL1 | 诺华股份有限公司 | 2016-08-24 | — | — | CN | disclosed |